(diphenylmethyl) 3-[2-(4-methoxyphenoxy)ethanoyloxymethyl]-8-oxidanylidene-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-[2-(4-methoxyphenoxy)ethanoyloxymethyl]-8-oxidanylidene-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 3-[[2-(4-methoxyphenoxy)acetyl]oxymethyl]-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-[[2-(4-methoxyphenoxy)-1-oxoethoxy]methyl]-8-oxo-7-[(1-oxo-2-phenylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-[[2-(4-methoxyphenoxy)acetyl]oxymethyl]-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-3-[[2-(4-methoxyphenoxy)acetyl]oxymethyl]-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C38H34N2O8S MolecularWeight: 678.75016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)OCC2=C(N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)OCC2=C(N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H34N2O8S/c1-45-29-17-19-30(20-18-29)46-23-32(42)47-22-28-24-49-37-33(39-31(41)21-25-11-5-2-6-12-25)36(43)40(37)34(28)38(44)48-35(26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-20,33,35,37H,21-24H2,1H3,(H,39,41)